ethyl 1-[2-[3-[(phenylmethyl)-thiophen-2-ylcarbonyl-amino]phenyl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[3-[(phenylmethyl)-thiophen-2-ylcarbonyl-amino]phenyl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3-[benzyl(thiophene-2-carbonyl)amino]phenyl]acetyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-2-[3-[[oxo(thiophen-2-yl)methyl]-(phenylmethyl)amino]phenyl]ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-[benzyl(thiophene-2-carbonyl)amino]phenyl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-[3-[benzyl(2-thenoyl)amino]phenyl]acetyl]nipecotic acid ethyl ester Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H30N2O4S/c1-2-34-28(33)23-12-7-15-29(20-23)26(31)18-22-11-6-13-24(17-22)30(19-21-9-4-3-5-10-21)27(32)25-14-8-16-35-25/h3-6,8-11,13-14,16-17,23H,2,7,12,15,18-20H2,1H3